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73387-51-6

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Basic Information
CAS No.: 73387-51-6
Name: 3-(4-Bromophenyl)-1-methyl-1H-pyrazole
Article Data: 4
Molecular Structure:
Molecular Structure of 73387-51-6 (3-(4-Bromophenyl)-1-methyl-1H-pyrazole)
Formula: C10H9BrN2
Molecular Weight: 237.099
Synonyms: 3-(4-Bromophenyl)-1-methyl-1H-pyrazole;
Density: 1.44 g/cm3
Melting Point: 79.5 °C
Boiling Point: 331.6 °C at 760 mmHg
Flash Point: 154.4 °C
PSA: 17.82000
LogP: 2.84960
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Specification

The 3-(4-Bromophenyl)-1-methyl-1H-pyrazole, with the CAS registry number 73387-51-6, is also known as 1H-Pyrazole, 3-(4-bromophenyl)-1-methyl-. This chemical's molecular formula is C10H9BrN2 and molecular weight is 237.10. Its systematic name is called 3-(4-bromophenyl)-1-methyl-1H-pyrazole.

Physical properties of 3-(4-Bromophenyl)-1-methyl-1H-pyrazole: (1)ACD/LogP: 2.83; (2)#H bond acceptors: 2; (3)#H bond donors: 0; (4)#Freely Rotating Bonds: 1; (5)Polar Surface Area: 17.82 Å2; (6)Index of Refraction: 1.625; (7)Molar Refractivity: 57.91 cm3; (8)Molar Volume: 163.6 cm3; (9)Surface Tension: 43.6 dyne/cm; (10)Density: 1.44 g/cm3; (11)Melting Point: 79.5 °C; (12)Flash Point: 154.4 °C; (13)Enthalpy of Vaporization: 55.15 kJ/mol; (14)Boiling Point: 331.6 °C at 760 mmHg; (15)Vapour Pressure: 0.000297 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Brc2ccc(c1nn(cc1)C)cc2
(2)InChI: InChI=1/C10H9BrN2/c1-13-7-6-10(12-13)8-2-4-9(11)5-3-8/h2-7H,1H3
(3)InChIKey: GZQYXOYGTVBFQA-UHFFFAOYAB